4-[(E)-2-(2,6-ditert-butylpyrylium-4-yl)ethenyl]phenol

Systemtic Name: 4-[(E)-2-(2,6-ditert-butylpyrylium-4-yl)ethenyl]phenol Openeye Name: 4-[(E)-2-(2,6-ditert-butylpyrylium-4-yl)vinyl]phenol CAS Name: 4-[(E)-2-(2,6-ditert-butyl-4-pyryliumyl)ethenyl]phenol IUPAC Name: 4-[(E)-2-(2,6-ditert-butylpyrylium-4-yl)ethenyl]phenol Traditional Name: 4-[(E)-2-(2,6-ditert-butylpyrylium-4-yl)vinyl]phenol Formula: C21H27O2+ MolecularWeight: 311.43788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=[O+]1)C(C)(C)C)C=CC2=CC=C(C=C2)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=[O+]1)C(C)(C)C)/C=C/C2=CC=C(C=C2)O

InChI

InChI=1S/C21H26O2/c1-20(2,3)18-13-16(14-19(23-18)21(4,5)6)8-7-15-9-11-17(22)12-10-15/h7-14H,1-6H3/p+1/b8-7+